Glycoside
GD030955
Name:
NoneFormula:
C9H16O6Smiles:
COC(=O)CC[C@@H]1O[C@H](OC)[C@H](O)[C@H]1OAglycone:
CCC(=O)OCSugarmoiety:
COC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.89 |
| AlogP: | -0.97 | Num_rotatable_bonds: | 4 |
| MolWt: | 220.22 | Num_heavy_atoms: | 15 |
| TPSA: | 85.22 | NumAromaticRings: | 0 |
Unique Aglycone
AD04957
Formula: C4H8O2
Smiles:
CCC(=O)OC| HBA: | 2 | RingCount: | 0 |
| HBD: | 0 | FractionCSP3: | 0.75 |
| AlogP: | 0.57 | Num_rotatable_bonds: | 1 |
| MolWt: | 88.11 | Num_heavy_atoms: | 6 |
| TPSA: | 26.3 | NumAromaticRings: | 0 |
